RefChem:337195

N,N-dimethyl-5-(4-methylpiperazin-4-ium-1-yl)-5,6-dihydrobenzo[b][1]benzothiepine-3-sulfonamide;methanesulfonate

Also Known As: AC1L1ZLK|RefChem:337195|Dibenzo(b,f)thiepin-8-sulfonamide, 10,11-dihydro-N,N-dimethyl-10-(4-methyl-1-piperazinyl)-, methanesulfonate, hydrate (1:1:1)|N,N-dimethyl-6-(4-methylpiperazin-4-ium-1-yl)-5,6-dihydrobenzo[b][1]benzothiepine-8-sulfonamide; methanesulfonate|DIBENZO(b,f)THIEPIN-8-SULFONAMIDE, 10,11-DIHYDRO-N,N-DIMETHYL-10-(4-METHYL-1-PIP|Dibenzo[b,f]thiepin-8-sulfonamide, 10,11-dihydro-N,N-dimethyl-10-(4-methyl-1-piperazinyl)-, monomethanesulfonate|N,N-dimethyl-5-(4-methylpiperazin-4-ium-1-yl)-5,6-dihydrobenzo[b][1]benzothiepine-3-sulfonamide; methanesulfonate

Molecular Formula	C22H31N3O5S3
Molecular Weight	513.1426 g/mol
LogP	0.68
Topological Polar Surface Area	102.26 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	3
Exact Mass	513.1426
Heavy Atoms	33
Complexity	1183.5

Chemical Identifiers

CAS Number	39841-98-0
SMILES	C[NH+]1CCN(CC1)C2CC3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C.CS(=O)(=O)[O-]